[4-(azepan-1-ylsulfonyl)phenyl]methyl-ethyl-azanium

Systemtic Name: [4-(azepan-1-ylsulfonyl)phenyl]methyl-ethyl-azanium Openeye Name: [4-(azepan-1-ylsulfonyl)phenyl]methyl-ethyl-ammonium CAS Name: [4-(1-azepanylsulfonyl)phenyl]methyl-ethylammonium IUPAC Name: [4-(azepan-1-ylsulfonyl)phenyl]methyl-ethylazanium Traditional Name: [4-(azepan-1-ylsulfonyl)benzyl]-ethyl-ammonium Formula: C15H25N2O2S+ MolecularWeight: 297.4362

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CC[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C15H24N2O2S/c1-2-16-13-14-7-9-15(10-8-14)20(18,19)17-11-5-3-4-6-12-17/h7-10,16H,2-6,11-13H2,1H3/p+1